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线性分子式:
ClC6H2(F)(CH3)CHO
化学文摘社编号:
分子量:
172.58
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
98%
InChI
1S/C8H6ClFO/c1-5-2-3-7(9)6(4-11)8(5)10/h2-4H,1H3
SMILES string
Cc1ccc(Cl)c(C=O)c1F
InChI key
GGZOMBUJFMOEEZ-UHFFFAOYSA-N
assay
98%
refractive index
n20/D 1.548 (lit.)
bp
249 °C (lit.)
density
1.3 g/mL at 25 °C (lit.)
General description
6-Chloro-2-fluoro-3-methylbenzaldehyde is also referred to as 6-chloro-2-fluoro-m-tolualdehyde. Toxicity of 6-Chloro-2-fluoro-3-methylbenzaldehyde in Tetrahymena pyriformis was established by developing a quantitative structure-activity relationship (QSAR) model.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
10 - Combustible liquids
wgk
WGK 3
flash_point_f
230.0 °F - closed cup
flash_point_c
110 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
新产品
此项目有
QSAR modeling of aquatic toxicity of aromatic aldehydes using artificial neural network (ANN) and multiple linear regression (MLR).
Louis B and Agrawal VK.
J. Ind. Chem. Soc., 88(1), 99-99 (2011)
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